Sherwin J Singer
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Sherwin J Singercomputer-science Degrees
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Engineering Computer Science
Sherwin J Singer's Degrees
- PhD Computer Science Stanford University
- Masters Electrical Engineering University of California, Berkeley
- Bachelors Computer Engineering University of California, Berkeley
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(Suggest an Edit or Addition)Sherwin J Singer's Published Works
Number of citations in a given year to any of this author's works
Total number of citations to an author for the works they published in a given year. This highlights publication of the most important work(s) by the author
Published Works
- Role of water in electron-initiated processes and radical chemistry: issues and scientific advances. (2005) (390)
- Density functional theory of nonuniform polyatomic systems. I. General formulation (1986) (293)
- Free energy functions in the extended RISM approximation (1985) (270)
- Controlling a chaotic system. (1991) (264)
- Hydration dynamics and time scales of coupled water-protein fluctuations. (2007) (212)
- Density functional theory of nonuniform polyatomic systems. II: Rational closures for integral equations (1986) (183)
- Graph Theoretical Generation and Analysis of Hydrogen-Bonded Structures with Applications to the Neutral and Protonated Water Cube and Dodecahedral Clusters (1998) (153)
- Potential models for simulations of the solvated proton in water (1998) (144)
- Model for the water-amorphous silica interface: the undissociated surface. (2007) (124)
- Computational analysis of the potential energy surfaces of glycerol in the gas and aqueous phases: effects of level of theory, basis set, and solvation on strongly intramolecularly hydrogen-bonded systems. (2001) (109)
- Theory of diatomic molecule photodissociation: Electronic angular momentum influence on fragment and fluorescence cross sections (1983) (108)
- On the use of graph invariants for efficiently generating hydrogen bond topologies and predicting physical properties of water clusters and ice (2001) (99)
- Hydrogen bond topology and the ice VII/VIII and Ih/XI proton ordering phase transitions. (2005) (79)
- DNA Binding to the Silica Surface. (2015) (73)
- The water-amorphous silica interface: analysis of the Stern layer and surface conduction. (2011) (69)
- Short H-bonds and spontaneous self-dissociation in (H2O)20: Effects of H-bond topology (2003) (67)
- POTENTIAL-ENERGY SURFACES AND VIBRATIONAL-SPECTRA OF H5O2+ AND LARGER HYDRATED PROTON COMPLEXES (1995) (66)
- A density functional treatment of the hard dumbbell freezing transition (1987) (61)
- Stochastic molecular dynamics study of cyclohexane isomerization (1988) (59)
- Electro-osmotic flow of a model electrolyte. (2005) (54)
- Origin of slow relaxation following photoexcitation of W7 in myoglobin and the dynamics of its hydration layer. (2008) (53)
- From BCS-like superconductivity to condensation of local pairs: A numerical study of the attractive Hubbard model. (1996) (52)
- Stripe melting in a two-dimensional system with competing interactions (2000) (51)
- Monte Carlo study of fluid-plastic crystal coexistence in hard dumbbells (1990) (49)
- Enumeration and Evaluation of the Water Hexamer Cage Structure (2000) (49)
- Photoalignment of liquid crystals by liquid crystals (2000) (48)
- The Dissociated Amorphous Silica Surface: Model Development and Evaluation. (2010) (44)
- Electronic energy shifts of a sodium atom in argon clusters by simulated annealing (1990) (43)
- Prediction of a phase transition to a hydrogen bond ordered form of ice VI. (2005) (41)
- A molecular dynamics study of Lys-Trp-Lys: structure and dynamics in solution following photoexcitation. (2006) (41)
- Structure and vibrational spectra of H+(H2O)8: Is the excess proton in a symmetrical hydrogen bond? (2000) (38)
- Radiative transitions associated with hole confinement at Si delta -doped planes in GaAs. (1992) (38)
- Evidence of type-I band offsets in strained GaAs1-xSbx/GaAs quantum wells from high-pressure photoluminescence. (1993) (37)
- Graph invariants for periodic systems: towards predicting physical properties from the hydrogen bond topology of ice. (2003) (34)
- Full Dimensional Quantum Calculations of Vibrational Energies of H5O2 (2003) (34)
- Topology versus temperature : Thermal behavior of H+(H2O)(8) and H+(H2O)(16) (2000) (33)
- A reexamination of the ice III/IX hydrogen bond ordering phase transition. (2006) (32)
- Cross sections and angular distributions for individual fragment fine structure levels produced in one‐ and two‐photon photodissociation of NaH (1984) (32)
- Hydrogen bond ordering in ice V and the transition to ice XIII. (2008) (31)
- Invariant imbedding solution of driven (inhomogeneous) and homogeneous Schrödinger equations (1982) (30)
- A Molecular Dynamics Study of the Electric Double Layer and Non-Linear Spectroscopy at the Amorphous Silica-Water Interface. (2019) (30)
- Layer buckling in smectic-A liquid crystals and two-dimensional stripe phases. (1993) (30)
- Experimental evidence for surface freezing in supercooled n-alkane nanodroplets. (2013) (30)
- GLOBAL ORIENTATIONAL ORDER IN MODEL POLAR CLUSTERS (1994) (29)
- Multichannel quantum theory for propagation of second order transition amplitudes (1987) (29)
- Non-monotonic dependence of electronic relaxation rate on solvent viscosity (1983) (28)
- An AIMD study of the CPD repair mechanism in water: reaction free energy surface and mechanistic implications. (2011) (28)
- An AIMD study of CPD repair mechanism in water: role of solvent in ring splitting. (2011) (27)
- Dissociation of a diatomic molecule to atomic fine structure states: Electronically nonadiabatic effects upon resonant two‐photon dissociation (1984) (26)
- Static and dynamic properties of the water/amorphous silica interface: a model for the undissociated surface (2007) (26)
- Domain-array melting in the dipolar lattice gas. (1992) (25)
- Electronic spectra of NaAr4 and NaAr6: Isomerization and melting (1992) (24)
- Computer simulations of a two-dimensional system with competing interactions. (2002) (24)
- Oscillatory structures in GaAs/(AlGa)As tunnel junctions. (1985) (24)
- Orientation, alignment, and hyperfine effects on dissociation of diatomic molecules to open shell atoms (1986) (24)
- Photodissociation of Diatomic Molecules to Open Shell Atoms (2007) (23)
- Domain energies of the dipolar lattice gas (1992) (22)
- Analysis of the subcritical carbon dioxide-water interface. (2011) (22)
- Hydrogen‐Bond Topology and Proton Ordering in Ice and Water Clusters (2011) (22)
- Hydrogen-bond topology and the ice VII/VIII and ice Ih/XI proton-ordering phase transitions. (2005) (22)
- Electric-field-induced layer buckling in chiral smectic-Aliquid crystals (1998) (21)
- Correlation Function Quantum Monte Carlo Study of the Excited Vibrational States of H5O2 (2004) (19)
- Photodissociation of homonuclear diatomics: Fine structure cross sections for Na2(X1Σg+) → Na(2S1/2) + Na(2P1/2,3/2 (1984) (18)
- Displacements, mean-squared displacements, and codisplacements for the calculation of nonequilibrium properties. (2014) (17)
- RISM calculation of the activation barrier for isomerization of solvated cyclohexane (1986) (17)
- ION SOLVATION IN MODEL POLAR CLUSTERS (1996) (16)
- Quantum Monte Carlo evidence for d-wave pairing in the two-dimensional Hubbard model at a van Hove singularity. (1996) (16)
- Local-mode analysis of complex zeolite vibrations: Zeolite-A (1994) (15)
- Non-adiabatic effects on the photodissociation of diatomic molecules to open-shell atoms. Resonances, polarizations and angular distributions for the CH+ model systems (1986) (15)
- Polarization charge: Theory and applications to aqueous interfaces. (2016) (14)
- Femtosecond solitons in nonlinear optical fibers: Classical and quantum effects. (1992) (13)
- Electronic angular momentum effects on photodissociation: fine structure cross sections and angular distributions for NaH → Na(2P12,32) + H(2S12) (1982) (13)
- Orientational ordering and anisotropy in model polar clusters (1995) (13)
- Measurements of device parameters on large arrays of Josephson interferometers (1980) (13)
- Low-energy resonances in photodissociation of CH+ (1984) (12)
- Pair correlations, cascading, and local-field effects in nonlinear optical susceptibilities. (1992) (12)
- Accurate non-local electron—argon pseudopotential for condensed phase simulation (1991) (11)
- Buckling induced by dilative strain in two- and three-dimensional layered materials (2000) (10)
- Local-mode analysis of complex zeolite vibrations: sodalite (1994) (10)
- Site disorder in ice VII arising from hydrogen bond fluctuations. (2009) (10)
- Incorporating advantages of time‐dependent dynamics in time‐independent collision methods: Early asymptotic analysis (1989) (9)
- Phase transitions at zero temperature in the dipolar lattice gas (1992) (9)
- A convergent analysis of radiative matrix elements in atomic lineshape theory (1986) (9)
- Hydrogen bonding in cubic(H2O)8andOH∙(H2O)7clusters (2005) (8)
- Automatic thermal cycling apparatus (1978) (8)
- A theoretical study of polymorphism in VQIVYK fibrils. (2021) (7)
- Scaling theory for two-dimensional systems with competing interactions. (2001) (7)
- Multiconfigurational electronic wave functions without a reference configuration: Analysis of a simulated annealing strategy (1990) (7)
- Behavior of point defects in a model crystal near melting. (1991) (6)
- On the determination of the crystal-vapor surface free energy, and why a Gaussian expression can be accurate for a system far from Gaussian. (2016) (6)
- Mechanism of surface freezing of alkanes. (2020) (5)
- Stochastic Molecular Dynamics Study of Cyclohexane Isomerization. (1988) (4)
- Nonadiabatic effects on the photodissociation of diatomic molecules to open-shell atoms. [CH/sup +/ + h nu. -->. C/sup +/(2²Pâ2, 3/2/) + H(1²S)] (1987) (4)
- Erratum: Orientation, alignment, and hyperfine effects on dissociation of diatomic molecules to open shell atoms [J. Chem. Phys. 84, 3762 (1986)] (1987) (3)
- Multiparticle Monte Carlo moves: Algorithm for solids with free-energy determination (1990) (3)
- Modeling Electroosmotic Flow in Nanochannels (2006) (3)
- Is aluminum-argon (AlAr12) icosahedral? (1992) (3)
- Biomolecules at the amorphous silica/water interface: Binding and fluorescence anisotropy of peptides. (2017) (3)
- Statistics of atomic populations in output coupled wave packets from Bose-Einstein condensates: Four-wave mixing (1999) (2)
- Dielectric Behavior near a Spherical Ion. (2021) (2)
- Renormalized finite-cluster expansions. (1987) (2)
- Surface freezing of n-octane nanodroplets (2013) (1)
- Dielectric spectrum of a DNA oligomer (2018) (1)
- MOLECULAR MECHANISMS IN THE REPAIR OF THE CYCLOBUTANE PYRIMIDINE DIMER (2009) (1)
- Full Dimensional Quantum Calculations of Vibrational Energies of H5O+2. (2003) (1)
- Hydration Dynamics As Revealed By The Fluorescence Stokes Shift: The Origin Of Slow Hydration Dynamics And Breakdown Of Linear Response (2009) (0)
- Kiwi-B-1A power and temperature control systems (1962) (0)
- FREEZING OF A DIATOMIC FLUID (1987) (0)
- Electronic Structure via Simulated Annealing Techniques: Solvent Shifts of Guest Atom Transition Frequencies in Rare Gas Clusters (1989) (0)
- Hydrogen bonding in cubic ÑH2OÖ8 and OH·ÑH2OÖ7 clusters (2005) (0)
- Is $AlAr_{12}$ ICOSAHEDRAL? (1992) (0)
- Cluster Structure and Re-structuring Upon Solvation of Ionic and Non-ionic Solutes (1996) (0)
- Chapter 19 Annealing to a moving target: first-principles molecular dynamics (1995) (0)
- Ice lh-Ice XI phase transition: A quantum mechanical study (2004) (0)
- Raman Spectroscopic Investigation of CO 2 Clathrate Formation (2005) (0)
- Interfacial Equilibria and Structure of Polyatomic Fluids from Interfacial-SAFT ( i SAFT ) Density Functional Theory (2006) (0)
- HYDRATED PROTON CLUSTERS (1996) (0)
- Comparison of molecular simulation with continuum theory for electroosmotic flow (2003) (0)
- ZWITTERIONS AND CAGES: NEW RESULTS FOR NEUTRAL AND PROTONATED WATER CLUSTERS (2001) (0)
- VIBRATIONAL SPECTRA OF THE $H_{5}{O_{2}}^{+}$ COMPLEX FROM THEORETICAL CALCULATIONS (1995) (0)
- DNA Binding to the Silica Surface B (2015) (0)
- Hydrogen bonding in cubic „ H 2 O (2005) (0)
- Recent Studies on Optimisation for Elastic Stability of Cylindrical and Conical Shells (2013) (0)
- Localized Mode Analysis Of Zeolite Complex Vibrational Motion (1993) (0)
- N 91-10303 REPEATED BUCKLING OF COMPOSITE SHEAR PANELS (0)
- Monte Carlo simulation of methyl chloride monolayer on the surface of graphite (2005) (0)
- A Realistic Model For The Water-amorphous Silica Interface: Insights Into The Electrical Double Layer And Bioengineering Applications (2009) (0)
- THEORETICAL RESULTS FOR $(H_{2}O)_{n}H^{+}$ AND $(H_{2}O)_{n}$: QMC FOR $H_{5}O_{2}^{+}$, GRAPH THEORETICAL ENUMERATION OF DISTINCT HYDROGEN-BONDED ARRANGEMENTS, COMPACT TO EXTENDED PHASE TRANSITIONS IN $(H_{2}O)_{n}H^{+}$ (1997) (0)
- Atomistic Simulations of Biomolecules at the Water‐Amorphous Silica Interface: Application to Peptides and DNA Oligomers (2012) (0)
- Patterns of Orientational Order in Polar Clusters (1994) (0)
- Hydrogen bond topology and proton ordering phase transitions in ice (2005) (0)
- Molecular Mechanisms in the Repair of the Cyclobutane Dimer (2009) (0)
- A DIFFUSION MONTE CARLO STUDY OF $H_{5}O_{2}^{+}$ (2002) (0)
- Electronic Energy Partitioning in Photodissociation (1983) (0)
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